Best AI tools for< Chemist >
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10 - AI tool Sites
Lavo Life Sciences
Lavo Life Sciences is an AI-accelerated crystal structure prediction application that helps in drug development by providing accurate predictions for small molecule drugs. The application utilizes AI technology to optimize solid-state formulations, reduce turnaround time, mitigate risks, and discover novel polymorphs, ultimately streamlining the pharmaceutical research and development process.
Cradle
Cradle is a protein engineering platform that uses machine learning to design improved protein sequences. It allows users to import assay data, generate new sequences, test them in the lab, and import the results to improve the model. Cradle can be used to optimize multiple properties of a protein simultaneously, and it has been used by leading biotech teams to accelerate new and ongoing projects.
Atomwise
Atomwise is an artificial intelligence (AI)-driven drug discovery company that uses machine learning to discover and develop new small molecule medicines. The company's AI engine combines the power of convolutional neural networks with massive chemical libraries to identify new drug candidates. Atomwise has a wholly owned pipeline of drug discovery programs and also partners with other pharmaceutical companies to co-develop drugs. The company's investors include prominent venture capital firms and pharmaceutical companies.
Recursion
Recursion is a techbio company that uses artificial intelligence to accelerate drug discovery. The company's platform combines hardware, software, and data to create a more efficient and effective drug discovery process. Recursion has a broad pipeline of drug candidates in development, and it has partnered with several leading pharmaceutical companies. The company is headquartered in Salt Lake City, Utah.
Institute for Protein Design
The Institute for Protein Design is a research institute at the University of Washington that uses computational design to create new proteins that solve modern challenges in medicine, technology, and sustainability. The institute's research focuses on developing new protein therapeutics, vaccines, drug delivery systems, biological devices, self-assembling nanomaterials, and bioactive peptides. The institute also has a strong commitment to responsible AI development and has developed a set of principles to guide its use of AI in research.
Allchemy
Allchemy is a resource-aware AI platform for drug discovery. It combines state-of-the-art computational synthesis with AI algorithms to predict molecular properties. Within minutes, Allchemy creates thousands of synthesizable lead candidates meeting user-defined profiles of drug-likeness, affinity towards specific proteins, toxicity, and a range of other physical-chemical measures. Allchemy encompasses the entire resource-to-drug design process and has been used in academic, corporate and classified environments worldwide to: Design synthesizable leads targeting specific proteins Evolve scaffolds similar to desired drugs Design “circular” drug syntheses from renewable materials Interface with and instruct automated synthesis platforms and optimize pilot-scale processes Operate “iterative synthesis” schemes Predict side reactions and create forensic “synthetic signatures” of hazardous/toxic molecules Design synthetic degradation and recovery cycles for various types of feedstocks and functional target molecules
C&EN
C&EN, a publication of the American Chemical Society, provides the latest news and insights on the chemical industry, including research, technology, business, and policy. It covers a wide range of topics, including analytical chemistry, biological chemistry, business, careers, education, energy, environment, food, materials, people, pharmaceuticals, physical chemistry, policy, research integrity, safety, and synthesis.
Atomwise
Atomwise is an AI-powered drug discovery company that uses machine learning to identify new small molecule medicines. The company's platform combines the power of convolutional neural networks with massive chemical libraries to discover new drug candidates. Atomwise has a portfolio of wholly owned and co-developed pipeline assets, and is backed by prominent investors.
Chemprop
Chemprop is a PyTorch-based framework for training and evaluating message-passing neural networks (MPNNs) for molecular property prediction. Originally developed for research purposes, Chemprop offers a comprehensive set of tools and features for training models and analyzing molecular representations. The package underwent a recent major release (v2.0.0) with significant improvements and updates.
PureSoft Labs OÜ
PureSoft Labs OÜ is a product-based tech startup based in Europe, committed to building B2B and B2C SaaS solutions — both AI-powered and traditional. They focus on responsible, ethical, and sustainable technology that serves its users. The company offers a range of AI-powered products designed to enhance education, mathematics, banking, homework solving, and chemistry assistance. Their products prioritize transparency, security, and performance, aiming to empower businesses and individuals with innovative and responsible technology solutions.
1 - Open Source Tools
ai2-kit
A toolkit for computational chemistry research, featuring tools to facilitate automated workflows. Includes tools for NMR prediction, dynamic catalysis research, proton transfer analysis, amorphous oxides structure analysis, reweighting, and more. Users can install 'ai2-kit' via pip and explore various domain-specific and general tools for processing system data and filtering structures by model deviation.
18 - OpenAI Gpts
NMR Spectra Interpreter
Identifies signals in 1H and 13C NMR spectra, suggesting possible structures.
Chemistry Lab Partner
Turbocharge your research and streamline your path to breakthrough findings. Leveraging the vast resources of PubChem, this GPT taps into a wealth of chemical data—from substances to proteins and patents—unleashing the full potential of your data for richer, more informed discoveries.
IR Spectra Interpreter
Analyzes IR spectra, prompts for uploads, and details findings in tables.
OpenTronsformer
Expert in automation engineering, generating Python code for Opentrons SDK.
Chemistry Expert
Advanced AI for chemistry, offering innovative solutions, process optimizations, and safety assessments, powered by OpenAI.
Chemistry Companion
Professional chemistry assistant, SMILES/SMART supported molecule and reaction diagrams, and more!
Formula Generator
Expert in generating and explaining mathematical, chemical, and computational formulas.
(Unofficial) GNoME Materials Discovery AI
Explore, render, and ask questions about materials discovered in the GNoME project
ElementGPT
Explore the fascinating world of elements with in-depth insights on chemistry, periodic table, and elemental properties. Dive into our comprehensive guide for a deeper understanding of the elements' significance in science and everyday life.
Chimica
Questo programma fornisce spiegazioni chiare su un'ampia gamma di argomenti di chimica. Gli utenti possono imparare tutto, dai concetti di base della chimica alle teorie più complesse. È stato progettato per rendere la chimica facile da capire per tutti.
Acid Extractor Assistant
Hello Acid Extractor! I'm your dedicated Acid Extractor Assistant here to assist you with all your acid extraction needs. Let's work together for successful extractions!